General Information of the Compound
| Compound ID |
CP0556996
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| Compound Name |
CHEMBL4778454
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| Formula |
C15H10FN3O3
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| Molecular Weight |
299.261
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| Canonical SMILES |
CC1(C)C(=O)c2[nH]c3cc(F)cc4c3c2c(n[nH]c4=O)C1=O
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| InChI |
InChI=1S/C15H10FN3O3/c1-15(2)12(20)10-9-8-6(3-5(16)4-7(8)17-10)14(22)19-18-11(9)13(15)21/h3-4,17H,1-2H3,(H,19,22)
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| InChIKey |
VOHZUJVLBHHRQQ-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound